Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIA | P62937 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | FABP7 | O15540 | 1/20 | 0.38 |
| ▸ | FABP3 | P05413 | 1/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2877767 | 0.81 | CYP1A2 (0.50) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 | |
| SCHEMBL29935885 | 0.79 | CYP1A2 (0.55) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 | |
| SCHEMBL9156343 | 0.79 | CYP1A2 (0.55) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11157053 | 0.77 | CYP1A2 (0.53) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 | |
| SCHEMBL88302 | 0.76 | HTR2A (0.45) | PPIAKMT2ACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL29579635 | 0.76 | HTR2A (0.45) | PPIAKMT2ACYP1A2CYP2D6CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL28099493 | 0.75 | HTR2A (0.44) | PPIAKMT2ACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19639248 | 0.73 | KMT2A (0.46) | PPIAKMT2ACYP1A2TSHRMAPT | |
| SCHEMBL5883325 | 0.73 | KMT2A (0.55) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 | |
| SCHEMBL25217366 | 0.72 | CYP1A2 (0.53) | ALDH1A1HPGDKMT2ACYP1A2CYP2D6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010043866-A2 | HISTONE LYSINE DEMETHYLASE INHIBITORS | ISIS INNOVATION LIMITED (GB) | 2010-04-22 | — | — | WO | disclosed |